Cas no 876316-61-9 (3-(chloromethyl)-1-methyl-5-thien-2-yl-1H-pyrazole)

3-(chloromethyl)-1-methyl-5-thien-2-yl-1H-pyrazole structure
876316-61-9 structure
Product Name:3-(chloromethyl)-1-methyl-5-thien-2-yl-1H-pyrazole
CAS No:876316-61-9
MF:C9H9ClN2S
MW:212.699159383774
CID:719611
PubChem ID:18525807
Update Time:2025-09-20

3-(chloromethyl)-1-methyl-5-thien-2-yl-1H-pyrazole Chemical and Physical Properties

Names and Identifiers

    • 1H-Pyrazole,3-(chloromethyl)-1-methyl-5-(2-thienyl)-
    • 3-(chloromethyl)-1-methyl-5-thien-2-yl-1H-pyrazole
    • 3-(chloromethyl)-1-methyl-5-thiophen-2-ylpyrazole
    • 3-(Chloromethyl)-1-methyl-5-(thiophen-2-yl)-1H-pyrazole
    • MS-22406
    • 876316-61-9
    • FT-0716013
    • AKOS008901218
    • DTXSID70594562
    • DB-077050
    • Inchi: 1S/C9H9ClN2S/c1-12-8(5-7(6-10)11-12)9-3-2-4-13-9/h2-5H,6H2,1H3
    • InChI Key: ODLZAEGCJDMPOT-UHFFFAOYSA-N
    • SMILES: ClCC1C=C(C2=CC=CS2)N(C)N=1

Computed Properties

  • Exact Mass: 212.01700
  • Monoisotopic Mass: 212.0174972g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 2
  • Complexity: 179
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2
  • Topological Polar Surface Area: 46.1?2

Experimental Properties

  • Density: 1.33
  • Melting Point: 41 °C
  • Boiling Point: 336.3°C at 760 mmHg
  • Flash Point: 157.2°C
  • Refractive Index: 1.653
  • PSA: 46.06000
  • LogP: 2.88740

3-(chloromethyl)-1-methyl-5-thien-2-yl-1H-pyrazole Security Information

  • Hazard Statement: Corrosive
  • Hazardous Material Identification: C

3-(chloromethyl)-1-methyl-5-thien-2-yl-1H-pyrazole Customs Data

  • HS CODE:2934999090
  • Customs Data:

    China Customs Code:

    2934999090

    Overview:

    2934999090. Other heterocyclic compounds. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

3-(chloromethyl)-1-methyl-5-thien-2-yl-1H-pyrazole Pricemore >>

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